2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum

C156H147N12O3Pt3-3 — CID 157293203

IUPAC2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESCc1cc(C)c(-c2cc(-c3ccncn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cnccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ncccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/3C52H49N4O.3Pt/c1-32-25-33(2)46(34(3)26-32)37-27-36(28-38(29-37)49-53-23-16-24-54-49)41-20-15-22-45-47(41)55-50(42-30-39(51(4,5)6)31-43(48(42)57)52(7,8)9)56(45)44-21-14-13-19-40(44)35-17-11-10-12-18-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-31-53-22-23-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-22-23-53-31-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;;;/h10-27,29-31,57H,1-9H3;2*10-25,27-31,57H,1-9H3;;;/q3*-1;;;
InChIKeyHQSSJROPRGAAHJ-UHFFFAOYSA-N
MW2823.21 g/mol
LogP39.52
Rot. Bonds18

About 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 157293203) has the molecular formula C156H147N12O3Pt3-3 and a molecular weight of 2823.21 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

Compound Name2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
PubChem CID157293203
Molecular FormulaC156H147N12O3Pt3-3
Molecular Weight2823.21 g/mol
Exact Mass2821.07
IUPAC Name2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
SMILESCc1cc(C)c(-c2cc(-c3ccncn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cnccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ncccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt]
InChIInChI=1S/3C52H49N4O.3Pt/c1-32-25-33(2)46(34(3)26-32)37-27-36(28-38(29-37)49-53-23-16-24-54-49)41-20-15-22-45-47(41)55-50(42-30-39(51(4,5)6)31-43(48(42)57)52(7,8)9)56(45)44-21-14-13-19-40(44)35-17-11-10-12-18-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-31-53-22-23-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-22-23-53-31-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;;;/h10-27,29-31,57H,1-9H3;2*10-25,27-31,57H,1-9H3;;;/q3*-1;;;
InChIKeyHQSSJROPRGAAHJ-UHFFFAOYSA-N
XLogP39.52
TPSA191.49 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002823.21
LogP ≤ 539.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum with MolForge

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Related Compounds

3-tert-butyl-N-[2-tert-butyl-5-(4-tert-butyl-2-pyridinyl)benzene-6-id-1-yl]-6-[10-(trifluoromethyl)benzo[g]quinazolin-4-yl]pyridin-2-amine;9-(4-tert-butyl-2-pyridinyl)-N-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]pyrido[2,3-b]indol-2-amine;2,4-ditert-butyl-6-[1-(4-tert-butyl-2-phenylphenyl)-4-[4-tert-butyl-6-[(4-phenyl-2-pyridinyl)amino]-2-pyridinyl]benzimidazol-2-yl]phenol;platinum;platinum(2+)
CID 157080983
CID 157462522
CID 157462522
CID 157617296
CID 157617296
CID 158157518
CID 158157518
CID 158239006
CID 158239006
CID 158431192
CID 158431192
Benzenesulfonyl-[2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]azanide;5-fluoro-2-(3-phenylimidazo[4,5-b]pyridin-2-yl)phenol;1-(3-phenyl-3a,7a-dihydroimidazo[4,5-b]pyridin-2-yl)naphthalen-2-ol;2-(3-phenylimidazo[4,5-b]pyridin-2-yl)pyren-1-ol;2-[3-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenol;ZINC
CID 158578822
CID 158636196
CID 158636196
CID 159096807
CID 159096807
2-[4-tert-butyl-6-[4-tert-butyl-6-(2-hydroxyphenyl)-2-pyridinyl]-2-pyridinyl]phenol;7,7-dimethyl-1,11-dihydrobenzo[a]phenalene-1,11-diide;3-(2,6-dimethylphenyl)-8-methyl-4-aza-1-azoniapentacyclo[13.2.1.04,17.05,10.011,16]octadeca-1(17),2,5(10),6,8,11,13,15-octaene;N,N-diphenyl-6H-pyrido[2,1-a]isoindol-5-ium-2-amine;bis(4-hydroxypent-3-en-2-one);tris(iridium);5-methyl-2-phenylpyridine;1-phenylisoquinoline;platinum;2-[4-(trifluoromethyl)benzene-6-id-1-yl]quinoline
CID 159471047
CID 159570252
CID 159570252
CID 159810756
CID 159810756

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The IUPAC name of 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (CID 157293203) is 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.
What is the SMILES notation for 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The canonical SMILES for 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum is Cc1cc(C)c(-c2cc(-c3ccncn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3cnccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.Cc1cc(C)c(-c2cc(-c3ncccn3)[c-]c(-c3cccc4c3nc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3O)n4-c3ccccc3-c3ccccc3)c2)c(C)c1.[Pt].[Pt].[Pt].
What is the InChIKey of 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
The InChIKey is HQSSJROPRGAAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C52H49N4O.3Pt/c1-32-25-33(2)46(34(3)26-32)37-27-36(28-38(29-37)49-53-23-16-24-54-49)41-20-15-22-45-47(41)55-50(42-30-39(51(4,5)6)31-43(48(42)57)52(7,8)9)56(45)44-21-14-13-19-40(44)35-17-11-10-12-18-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-31-53-22-23-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;1-32-24-33(2)47(34(3)25-32)38-27-36(26-37(28-38)44-22-23-53-31-54-44)41-19-15-21-46-48(41)55-50(42-29-39(51(4,5)6)30-43(49(42)57)52(7,8)9)56(46)45-20-14-13-18-40(45)35-16-11-10-12-17-35;;;/h10-27,29-31,57H,1-9H3;2*10-25,27-31,57H,1-9H3;;;/q3*-1;;;.
What are the key properties of 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?
2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 2823.21 g/mol, XLogP of 39.52, 18 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrazin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-2-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;2,4-ditert-butyl-6-[1-(2-phenylphenyl)-4-[3-pyrimidin-4-yl-5-(2,4,6-trimethylphenyl)benzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 157293203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).